N-[(1S)-1-[2-[cyclohexyl(methyl)amino]-4-methyl-pyrimidin-5-yl]ethyl]-1-methyl-piperidin-1-ium-4-carboxamide

Systemtic Name: N-[(1S)-1-[2-[cyclohexyl(methyl)amino]-4-methyl-pyrimidin-5-yl]ethyl]-1-methyl-piperidin-1-ium-4-carboxamide Openeye Name: N-[(1S)-1-[2-[cyclohexyl(methyl)amino]-4-methyl-pyrimidin-5-yl]ethyl]-1-methyl-piperidin-1-ium-4-carboxamide CAS Name: N-[(1S)-1-[2-[cyclohexyl(methyl)amino]-4-methyl-5-pyrimidinyl]ethyl]-1-methyl-4-piperidin-1-iumcarboxamide IUPAC Name: N-[(1S)-1-[2-[cyclohexyl(methyl)amino]-4-methylpyrimidin-5-yl]ethyl]-1-methylpiperidin-1-ium-4-carboxamide Traditional Name: N-[(1S)-1-[2-[cyclohexyl(methyl)amino]-4-methyl-pyrimidin-5-yl]ethyl]-1-methyl-piperidin-1-ium-4-carboxamide Formula: C21H36N5O+ MolecularWeight: 374.54344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(C)NC(=O)C2CC[NH+](CC2)C)N(C)C3CCCCC3

Isomeric SMILES

CC1=NC(=NC=C1[C@H](C)NC(=O)C2CC[NH+](CC2)C)N(C)C3CCCCC3

InChI

InChI=1S/C21H35N5O/c1-15(23-20(27)17-10-12-25(3)13-11-17)19-14-22-21(24-16(19)2)26(4)18-8-6-5-7-9-18/h14-15,17-18H,5-13H2,1-4H3,(H,23,27)/p+1/t15-/m0/s1